K(DyS2)2
Alexandria ALEXAlex-ID: agm096652018 · Space group: P2/m (#10)
Basic Information
Composition
Energy & Stability
Electronic Structure
Additional Information
AB2C4_179_spg10
Dy10S19 KS5 KDyS2
2025-04-11 13:15:39
Citation
The crystal structure and related material properties of this entry were obtained from the Alexandria database (Alex-ID: agm096652018).
Th. Cavignac, J. Schmidt, P.-P. De Breuck, A. Loew, T. F. T. Cerqueira, H.-C. Wang, A. Bochkarev, Y. Lysogorskiy, A. H. Romero, R. Drautz, S. Botti and M. A. L. Marques. AI-Driven expansion and application of the Alexandria database. J. Phys. Mater. 9, 025014 (2026). https://doi.org/10.1088/2515-7639/ae6620
@article{Cavignac2026Alexandria,
author = {Cavignac, Th{\'e}o and Schmidt, Jonathan and De Breuck, Pierre-Paul and Loew, Antoine
and Cerqueira, Tiago F. T. and Wang, Hai-Chen and Bochkarev, Anton
and Lysogorskiy, Yury and Romero, Aldo H. and Drautz, Ralf and Botti, Silvana
and Marques, Miguel A. L.},
title = {{AI}-Driven expansion and application of the {A}lexandria database},
journal = {Journal of Physics: Materials},
year = {2026},
volume = {9},
number = {2},
pages = {025014},
doi = {10.1088/2515-7639/ae6620},
url = {https://doi.org/10.1088/2515-7639/ae6620}
}
3D Crystal Structure Rendering
Loading 3D structure…
# CIF generated by HEAS from Alexandria entry agm096652018
data_agm096652018
_cell_length_a 6.81732
_cell_length_b 4.01826
_cell_length_c 7.83414
_cell_angle_alpha 90.00000
_cell_angle_beta 89.25029
_cell_angle_gamma 90.00000
_cell_volume 214.58807
_symmetry_space_group_name_H-M 'P 1'
_symmetry_Int_Tables_number 1
loop_
_symmetry_equiv_pos_as_xyz
'x, y, z'
loop_
_atom_site_label
_atom_site_type_symbol
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
_atom_site_occupancy
K1 K 0.00051 0.50000 0.50010 1.00000
Dy1 Dy 0.99992 0.50000 0.00009 1.00000
Dy2 Dy 0.49992 0.00000 0.99988 1.00000
S1 S 0.84060 0.00000 0.80750 1.00000
S2 S 0.33606 0.50000 0.81169 1.00000
S3 S 0.66356 0.50000 0.18811 1.00000
S4 S 0.15944 0.00000 0.19263 1.00000
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